2-ethylsulfanyl-4-oxidanyl-5-(phenylmethyl)-1H-pyrimidin-6-one

Systemtic Name: 2-ethylsulfanyl-4-oxidanyl-5-(phenylmethyl)-1H-pyrimidin-6-one Openeye Name: 5-benzyl-2-ethylsulfanyl-4-hydroxy-1H-pyrimidin-6-one CAS Name: 2-(ethylthio)-4-hydroxy-5-(phenylmethyl)-1H-pyrimidin-6-one IUPAC Name: 5-benzyl-2-ethylsulfanyl-4-hydroxy-1H-pyrimidin-6-one Traditional Name: 5-benzyl-2-(ethylthio)-4-hydroxy-1H-pyrimidin-6-one Formula: C13H14N2O2S MolecularWeight: 262.32746

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCSC1=NC(=C(C(=O)N1)CC2=CC=CC=C2)O

Isomeric SMILES

CCSC1=NC(=C(C(=O)N1)CC2=CC=CC=C2)O

InChI

InChI=1S/C13H14N2O2S/c1-2-18-13-14-11(16)10(12(17)15-13)8-9-6-4-3-5-7-9/h3-7H,2,8H2,1H3,(H2,14,15,16,17)